ChemSpider 2D Image | 3-Bromo-2-formylbenzoic acid | C8H5BrO3

3-Bromo-2-formylbenzoic acid

  • Molecular FormulaC8H5BrO3
  • Average mass229.027 Da
  • Monoisotopic mass227.942200 Da
  • ChemSpider ID25077250

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Brom-2-formylbenzoesäure [German] [ACD/IUPAC Name]
3-Bromo-2-formylbenzoic acid [ACD/IUPAC Name]
503821-93-0 [RN]
Acide 3-bromo-2-formylbenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-2-formyl- [ACD/Index Name]
3-bromo-2-formylbenzoate
3-Bromo-2-formyl-benzoic acid
AGN-PC-09P3H9
AKOS005209308
bromo-2-formylbenzoic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.8±0.1 g/cm3
    Boiling Point: 363.9±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.4±3.0 kJ/mol
    Flash Point: 173.9±25.1 °C
    Index of Refraction: 1.655
    Molar Refractivity: 47.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.62
    ACD/LogD (pH 5.5): 0.72
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 14.52
    ACD/LogD (pH 7.4): -0.83
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 54 Å2
    Polarizability: 18.9±0.5 10-24cm3
    Surface Tension: 62.5±3.0 dyne/cm
    Molar Volume: 129.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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